(4-pyrimidin-2-ylpiperazin-1-yl)-[(2S)-1-thiophen-2-ylcarbonylpyrrolidin-2-yl]methanone

Systemtic Name: (4-pyrimidin-2-ylpiperazin-1-yl)-[(2S)-1-thiophen-2-ylcarbonylpyrrolidin-2-yl]methanone Openeye Name: (4-pyrimidin-2-ylpiperazin-1-yl)-[(2S)-1-(thiophene-2-carbonyl)pyrrolidin-2-yl]methanone CAS Name: [(2S)-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (4-pyrimidin-2-ylpiperazin-1-yl)-[(2S)-1-(thiophene-2-carbonyl)pyrrolidin-2-yl]methanone Traditional Name: [4-(2-pyrimidyl)piperazino]-[(2S)-1-(2-thenoyl)pyrrolidin-2-yl]methanone Formula: C18H21N5O2S MolecularWeight: 371.45664

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC=CS2)C(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

C1C[C@H](N(C1)C(=O)C2=CC=CS2)C(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C18H21N5O2S/c24-16(14-4-1-8-23(14)17(25)15-5-2-13-26-15)21-9-11-22(12-10-21)18-19-6-3-7-20-18/h2-3,5-7,13-14H,1,4,8-12H2/t14-/m0/s1